Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5938664651
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
| Name | File |
|---|---|
| SDF | MCULE-5938664651.sdf |
| SMILES | MCULE-5938664651.smiles |
| Standard InChI | MCULE-5938664651.inchi |
| InChIKey | MCULE-5938664651.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867552717 | 98 | As is | in stock |
| P-875711188 | N/A | As is | in stock |
| P-869187633 | 98 | As is | in stock |
| P-505396309 | 99 | As is | in stock |
| P-903037773 | 98 | As is | 2 kg |
| P-905485138 | 95 | As is | 10 g |
| P-606941924 | N/A | As is | in stock |
| P-596942150 | 98 | As is | 1000 g |
| P-494333324 | 95 | As is | by resynthesis (? - ? days) |
| P-864127055 | 95 | As is | in stock |
| P-580698931 | 98 | As is | 11 g |
| P-504742673 | 90 | As is | 1 mg |
| P-619303581 | 90 | As is | 24 mg |
| P-20011312 | 90 | As is | in stock |
| P-868572332 | 98 | As is | in stock |
| P-34797655 | 90 | As is | by synthesis |
| P-580271108 | 95 | As is | by resynthesis (? - ? days) |
| P-904201818 | N/A | As is | in stock |
| P-905321269 | 98 | As is | 39.6 g |
| P-579489600 | 90 | As is | 3.93 g |
| P-454359893 | 90 | As is | 93 mg |
| P-579691484 | 95 | As is | by resynthesis (? - ? days) |
| P-852235172 | 90 | As is | 65 mg |
| P-580509315 | 95 | As is | by synthesis |
| P-852520573 | N/A | As is | in stock |
| P-854748893 | 95 | As is | in stock |
| P-34045762 | 90 | As is | 1000 mg |
| P-620227801 | 95 | As is | 1000 mg |
| P-500388574 | 98 | As is | by synthesis |
| P-859960531 | 95 | As is | by synthesis |
| P-23886075 | 90 | As is | in stock |
| P-596790226 | 90 | As is | 772 g |
| P-22534617 | 90 | As is | 469 mg |
| P-906761851 | 98 | As is | by synthesis |
| P-615449540 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.277 |
| logP | 3.1143 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 47.45 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.468 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
